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Target
Collagenase 3
Ligand
BDBM50300466
Substrate
n/a
Meas. Tech.
ChEMBL_592285 (CHEMBL1045859)
IC50
>98000±n/a nM
Citation
 Holmes, IP; Gaines, S; Watson, SP; Lorthioir, O; Walker, A; Baddeley, SJ; Herbert, S; Egan, D; Convery, MA; Singh, OM; Gross, JW; Strelow, JM; Smith, RH; Amour, AJ; Brown, D; Martin, SL The identification of beta-hydroxy carboxylic acids as selective MMP-12 inhibitors. Bioorg Med Chem Lett 19:5760-3 (2009) [PubMed]  Article 
Target
Name:
Collagenase 3
Synonyms:
MMP-13 | MMP13 | MMP13_HUMAN | Matrix metalloproteinase-13 | Matrix metalloproteinase-13 (MMP-13) | Matrix metalloproteinase-13 (MMP13)
Type:
Enzyme
Mol. Mass.:
53808.06
Organism:
Homo sapiens (Human)
Description:
P45452
Residue:
471
Sequence:
MHPGVLAAFLFLSWTHCRALPLPSGGDEDDLSEEDLQFAERYLRSYYHPTNLAGILKENAASSMTERLREMQSFFGLEVTGKLDDNTLDVMKKPRCGVPDVGEYNVFPRTLKWSKMNLTYRIVNYTPDMTHSEVEKAFKKAFKVWSDVTPLNFTRLHDGIADIMISFGIKEHGDFYPFDGPSGLLAHAFPPGPNYGGDAHFDDDETWTSSSKGYNLFLVAAHEFGHSLGLDHSKDPGALMFPIYTYTGKSHFMLPDDDVQGIQSLYGPGDEDPNPKHPKTPDKCDPSLSLDAITSLRGETMIFKDRFFWRLHPQQVDAELFLTKSFWPELPNRIDAAYEHPSHDLIFIFRGRKFWALNGYDILEGYPKKISELGLPKEVKKISAAVHFEDTGKTLLFSGNQVWRYDDTNHIMDKDYPRLIEEDFPGIGDKVDAVYEKNGYIYFFNGPIQFEYSIWSNRIVRVMPANSILWC
  
Inhibitor
Name:
BDBM50300466
Synonyms:
5-(4'-(benzyloxy)biphenyl-4-yl)-3-hydroxypentanoic acid | CHEMBL572926
Type:
Small organic molecule
Emp. Form.:
C24H24O4
Mol. Mass.:
376.445
SMILES:
OC(CCc1ccc(cc1)-c1ccc(OCc2ccccc2)cc1)CC(O)=O
Structure:
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